3
Lattice="3.344446227896275 0.0 0.0 -1.6722231139481376 2.896375394949214 0.0 0.0 0.0 18.12443889341874" Properties=species:S:1:pos:R:3 energy=-21.736436214138052 dipole="3.014504351425998 -1.7404248987690991 1.011283554808031e-08" free_energy=-21.74792289799584 pbc="T T F"
Nb      -0.00000000       0.00000000       9.06221945
S        1.67222311       0.96545846      10.62271716
S        1.67222311       0.96545846       7.50172173